Dimethylformamide → HCID 178508755, compound

HRID 154020Notes

Reaction equation

HRID 154020 reaction equation
[CH2:49]([c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1)[O:56][c:57]1[cH:58][cH:59][c:60]([CH2:63][CH2:64][C:65](=[O:66])[OH:67])[cH:61][cH:62]1.[CH3:68][N:69]1[CH2:70][CH2:71][O:72][CH2:73][CH2:74]1.[NH2:1][c:2]1[c:3]([C:10](=[O:11])[N:12]=[C:13]2[NH:14][CH2:15][C:16]3([CH2:17][CH:18]4[CH2:19][CH2:20][CH:21]([CH2:22]3)[NH:23]4)[NH:24]2)[n:4][c:5]([Cl:9])[c:6]([NH2:8])[n:7]1.[O:75]=[CH:76][N:77]([CH3:78])[CH3:79].[P-:25]([F:26])([F:27])([F:28])([F:29])([F:30])[F:31].[n:32]1([O:33][C:34]([N:35]([CH3:36])[CH3:37])=[N+:38]([CH3:39])[CH3:40])[c:41]2[n:42][cH:43][cH:44][cH:45][c:46]2[n:47][n:48]1>>[NH2:1][c:2]1[c:3]([C:10](=[O:11])[N:12]=[C:13]2[NH:14][CH2:15][C:16]3([CH2:17][CH:18]4[CH2:19][CH2:20][CH:21]([CH2:22]3)[N:23]4[C:65]([CH2:64][CH2:63][c:60]3[cH:59][cH:58][c:57]([O:56][CH2:49][c:50]4[cH:51][cH:52][cH:53][cH:54][cH:55]4)[cH:62][cH:61]3)=[O:66])[NH:24]2)[n:4][c:5]([Cl:9])[c:6]([NH2:8])[n:7]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 79724-MethylmorpholineHCID 9886HexafluorophosphateHCID 5613723-(4-Benzyloxyphenyl)propionic acidHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 178508757HCID 178508757, compound

Product 1

HCID 178508755HCID 178508755, compound

Sources & evidence

ORD record
ord-12e2c305d8f34addb7146584fea02cf4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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